1-[(4-cyanophenyl)methyl]-3-(3,4-dichlorophenyl)thiourea

Systemtic Name: 1-[(4-cyanophenyl)methyl]-3-(3,4-dichlorophenyl)thiourea Openeye Name: 1-[(4-cyanophenyl)methyl]-3-(3,4-dichlorophenyl)thiourea CAS Name: 1-[(4-cyanophenyl)methyl]-3-(3,4-dichlorophenyl)thiourea IUPAC Name: 1-[(4-cyanophenyl)methyl]-3-(3,4-dichlorophenyl)thiourea Traditional Name: 1-(4-cyanobenzyl)-3-(3,4-dichlorophenyl)thiourea Formula: C15H11Cl2N3S MolecularWeight: 336.23894

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=S)NC2=CC(=C(C=C2)Cl)Cl)C#N

Isomeric SMILES

C1=CC(=CC=C1CNC(=S)NC2=CC(=C(C=C2)Cl)Cl)C#N

InChI

InChI=1S/C15H11Cl2N3S/c16-13-6-5-12(7-14(13)17)20-15(21)19-9-11-3-1-10(8-18)2-4-11/h1-7H,9H2,(H2,19,20,21)